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Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock protein 90 inhibitors. | LitMetric
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Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock protein 90 inhibitors.

Timothy Neubert Mehdi Numa Justin Ernst Jeremy Clemens Paul Krenitsky Michael Liu Beth Fleck Lisa Woody Harmon Zuccola Dean Stamos

Bioorg Med Chem Lett

Vertex Pharmaceuticals Incorporated, Department of Chemistry, 11010 Torreyana Road, San Diego, CA 92121, United States.

Published: March 2015

Two novel series of oxazepine and diazepine based HSP90 inhibitors are reported. This effort relied on structure based design and isothermal calorimetry to identify small drug like macrocycles. Computational modelling was used to build into a solvent exposed pocket near the opening of the ATP binding site, which led to potent inhibitors of HSP90 (25-30).

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http://dx.doi.org/10.1016/j.bmcl.2015.01.023DOI Listing

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